3-methyl-5-oxidanylidene-5-(1,3-thiazol-2-ylamino)pentanoic acid

Systemtic Name: 3-methyl-5-oxidanylidene-5-(1,3-thiazol-2-ylamino)pentanoic acid Openeye Name: 3-methyl-5-oxo-5-(thiazol-2-ylamino)pentanoic acid CAS Name: 3-methyl-5-oxo-5-(2-thiazolylamino)pentanoic acid IUPAC Name: 3-methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid Traditional Name: 5-keto-3-methyl-5-(thiazol-2-ylamino)valeric acid Formula: C9H12N2O3S MolecularWeight: 228.26818

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NC=CS1)CC(=O)O

Isomeric SMILES

CC(CC(=O)NC1=NC=CS1)CC(=O)O

InChI

InChI=1S/C9H12N2O3S/c1-6(5-8(13)14)4-7(12)11-9-10-2-3-15-9/h2-3,6H,4-5H2,1H3,(H,13,14)(H,10,11,12)